Home Carbonyls 2-{[(tert-butoxy)carbonyl]amino}-4-oxopentanoic acid

2-{[(tert-butoxy)carbonyl]amino}-4-oxopentanoic acid

CAS No.:
160080-53-5
Catalog Number:
AG01AFB7
Molecular Formula:
C10H17NO5
Molecular Weight:
231.2457
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Product Description
Catalog Number:
AG01AFB7
Chemical Name:
2-{[(tert-butoxy)carbonyl]amino}-4-oxopentanoic acid
CAS Number:
160080-53-5
Molecular Formula:
C10H17NO5
Molecular Weight:
231.2457
MDL Number:
MFCD24135199
IUPAC Name:
2-[(2-methylpropan-2-yl)oxycarbonylamino]-4-oxopentanoic acid
InChI:
InChI=1S/C10H17NO5/c1-6(12)5-7(8(13)14)11-9(15)16-10(2,3)4/h7H,5H2,1-4H3,(H,11,15)(H,13,14)
InChI Key:
JMUJSOFKNKGLRT-UHFFFAOYSA-N
SMILES:
CC(=O)CC(C(=O)O)NC(=O)OC(C)(C)C
Properties
Complexity:
292  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
231.111g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
231.248g/mol
Monoisotopic Mass:
231.111g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
92.7A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
0.2  
Properties